2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide

C18H17N3O2 — CID 123527468

IUPAC2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
SMILESO=C(Nc1ccccc1)C1CC2(CN1)C(=O)Nc1ccccc12
InChIInChI=1S/C18H17N3O2/c22-16(20-12-6-2-1-3-7-12)15-10-18(11-19-15)13-8-4-5-9-14(13)21-17(18)23/h1-9,15,19H,10-11H2,(H,20,22)(H,21,23)
InChIKeyLLOGZQSLKLYVPN-UHFFFAOYSA-N
MW307.35 g/mol
LogP1.88
Rot. Bonds2

About 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide

2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide (PubChem CID 123527468) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide.

Molecular Properties

Compound Name2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
PubChem CID123527468
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
SMILESO=C(Nc1ccccc1)C1CC2(CN1)C(=O)Nc1ccccc12
InChIInChI=1S/C18H17N3O2/c22-16(20-12-6-2-1-3-7-12)15-10-18(11-19-15)13-8-4-5-9-14(13)21-17(18)23/h1-9,15,19H,10-11H2,(H,20,22)(H,21,23)
InChIKeyLLOGZQSLKLYVPN-UHFFFAOYSA-N
XLogP1.88
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-hydroxyacetyl)phenyl]-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
CID 172708107
(2'S,3S)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carbohydrazide
CID 163846050
N-[4-(3-amino-3-oxopropyl)phenyl]-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
CID 172710291
5'-oxo-N-phenylspiro[1,2-dihydroindole-3,4'-pyrrolidine]-2'-carboxamide
CID 141300537
N-(4-acetyl-2-methoxyphenyl)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
CID 172757933
N-(2-butoxy-4-carbamoylphenyl)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
CID 172684257
5-deuterio-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
CID 175928748
N-[4-(dimethylcarbamoyl)phenyl]-5'-oxospiro[1,2-dihydroindole-3,4'-pyrrolidine]-2'-carboxamide
CID 123762700
5-(2,2-dimethylpropyl)-N-(2-methyl-6-oxo-1H-pyridin-4-yl)-2-oxospiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide
CID 67227597
3-[(2'R,3R)-2'-isocyano-2-oxospiro[1H-indole-3,4'-pyrrolidine]-1'-yl]-2,2-dimethyl-3-oxo-N-phenylpropanamide
CID 168758760
(2S,3S,8R)-2'-oxo-N-phenylspiro[1,2,5,6,7,8-hexahydropyrrolizine-3,3'-1H-indole]-2-carboxamide
CID 162978594
spiro[1H-indole-3,1'-cyclopropane]-2-one;hydrochloride
CID 141126988

Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide?
The IUPAC name of 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide (CID 123527468) is 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide.
What is the SMILES notation for 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide?
The canonical SMILES for 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide is O=C(Nc1ccccc1)C1CC2(CN1)C(=O)Nc1ccccc12.
What is the InChIKey of 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide?
The InChIKey is LLOGZQSLKLYVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c22-16(20-12-6-2-1-3-7-12)15-10-18(11-19-15)13-8-4-5-9-14(13)21-17(18)23/h1-9,15,19H,10-11H2,(H,20,22)(H,21,23).
What are the key properties of 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide?
2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 1.88, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-phenylspiro[1H-indole-3,4'-pyrrolidine]-2'-carboxamide is sourced from PubChem (CID 123527468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).